1609 -OEChem-10051720353D 17 18 0 0 0 0 0 0 0999 V2000 1.6742 -2.6344 0.0006 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7118 -0.1731 0.0006 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.5529 1.3879 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1171 2.9128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3131 -0.7059 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7407 0.6301 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2965 -1.7104 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1305 -0.9896 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 0.9503 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2375 1.7409 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6574 -1.3911 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0623 -0.0619 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 0.0445 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0344 -2.7651 -0.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4448 1.9834 0.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3992 -2.1847 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1194 0.1862 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 2 13 1 0 0 0 0 3 10 1 0 0 0 0 3 13 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 7 14 1 0 0 0 0 8 13 2 0 0 0 0 9 12 1 0 0 0 0 9 15 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 17 1 0 0 0 0 M END > DB04459 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/SUGXUUGGLDCZKB-UHFFFAOYSA-N/SDF?record_type=3d > ClC1=C(Cl)C2=CC=CC=C2C(=O)O1 > InChI=1S/C9H4Cl2O2/c10-7-5-3-1-2-4-6(5)9(12)13-8(7)11/h1-4H > SUGXUUGGLDCZKB-UHFFFAOYSA-N > C9H4Cl2O2 > 215.033 > 213.958834786 > 1 > 17 > 0.0 > 18.647167210521246 > 1 > 0 > 0 > 0 > 3,4-dichloro-1H-isochromen-1-one > 3.14 > 2.876764642666666 > -3.49 > 0 > 0 > 2 > 0 > -7.093804122933593 > 26.3 > 61.05240000000001 > 0 > 1 > 6.97e-02 g/l > biotin > 1 $$$$